N-(4-methoxyphenyl)-2-(2-thiophen-2-ylquinazolin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-(4-methoxyphenyl)-2-(2-thiophen-2-ylquinazolin-4-yl)sulfanyl-ethanamide Openeye Name: N-(4-methoxyphenyl)-2-[2-(2-thienyl)quinazolin-4-yl]sulfanyl-acetamide CAS Name: N-(4-methoxyphenyl)-2-[(2-thiophen-2-yl-4-quinazolinyl)thio]acetamide IUPAC Name: N-(4-methoxyphenyl)-2-(2-thiophen-2-ylquinazolin-4-yl)sulfanylacetamide Traditional Name: N-(4-methoxyphenyl)-2-[[2-(2-thienyl)quinazolin-4-yl]thio]acetamide Formula: C21H17N3O2S2 MolecularWeight: 407.50858

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)CSC2=NC(=NC3=CC=CC=C32)C4=CC=CS4

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)CSC2=NC(=NC3=CC=CC=C32)C4=CC=CS4

InChI

InChI=1S/C21H17N3O2S2/c1-26-15-10-8-14(9-11-15)22-19(25)13-28-21-16-5-2-3-6-17(16)23-20(24-21)18-7-4-12-27-18/h2-12H,13H2,1H3,(H,22,25)